CID 44778

63833-90-9

Structural Information

Molecular Formula
C8H11NO3
SMILES
CCNC(=O)C(C1=CC=CO1)O
InChI
InChI=1S/C8H11NO3/c1-2-9-8(11)7(10)6-4-3-5-12-6/h3-5,7,10H,2H2,1H3,(H,9,11)
InChIKey
IKWNXBMYMBMNKP-UHFFFAOYSA-N
Compound name
N-ethyl-2-(furan-2-yl)-2-hydroxyacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

169.0739 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.081176 136.4
[M+Na]+ 192.063118 142.4
[M-H]- 168.066624 139.3
[M+NH4]+ 187.107723 156.0
[M+K]+ 208.037058 142.7
[M+H-H2O]+ 152.071160 130.7
[M+HCOO]- 214.072101 159.3
[M+CH3COO]- 228.087751 176.8
[M+Na-2H]- 190.048566 141.0
[M]+ 169.07335142 136.7
[M]- 169.07444858 136.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe